SCHEMBL21319946

SCHEMBL21319946

C1=Cc2c(n(-c3ccccc3)c3ccc(-c4cccc(-n5c6ccccc6c6ccc(-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7)cc65)c4)cc23)CC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PTGER4 P35408 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24860522 0.99 KDM4E (0.34) KDM4EATML3MBTL1PTGER4
SCHEMBL19774400 0.95 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL12966441 0.95 KDM4E (0.35) KDM4EATML3MBTL1PTGER4
SCHEMBL25916046 0.95 KDM4E (0.35) KDM4EATML3MBTL1PTGER4
SCHEMBL21319931 0.94 KDM4E (0.30) KDM4EATML3MBTL1
SCHEMBL9891180 0.94 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL21320437 0.94 KDM4E (0.33) KDM4EATML3MBTL1PTGER4
SCHEMBL21319866 0.93 KDM4E (0.35) KDM4EATML3MBTL1PTGER4
SCHEMBL21320229 0.93 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL21319929 0.93 KDM4E (0.32) KDM4EATML3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3015465-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2019-09-04 — — EP disclosed
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